N4-[2-(cyclohexen-1-yl)ethyl]-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[2-(cyclohexen-1-yl)ethyl]-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[2-(cyclohexen-1-yl)ethyl]-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[2-(1-cyclohexenyl)ethyl]-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[2-(cyclohexen-1-yl)ethyl]-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 2-(cyclohexen-1-yl)ethyl-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H25N5O3 MolecularWeight: 335.4014

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CCCCC2

Isomeric SMILES

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CCCCC2

InChI

InChI=1S/C16H25N5O3/c1-24-11-5-9-17-15-14(21(22)23)16(20-12-19-15)18-10-8-13-6-3-2-4-7-13/h6,12H,2-5,7-11H2,1H3,(H2,17,18,19,20)